aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19231 | 1.5 | 1552.61 | C66H71O26N10P2Cl3 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)OCC(=O)NC(P(=O)(O)O)P(=O)(O)O)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(N)C(O)C(C)O3)c3cc(Cl)c(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD19232 | 1.74 | 218.25 | C13H14O3 | C=C(CO)C1Cc2cc(C(C)=O)ccc2O1 |
|
AD19233 | -0.5 | 178.18 | C7H8ON5 | Nc1nc(CCO)nc2c1N=C[N]2 |
|
AD19234 | 3.19 | 759.93 | C38H63O10N3F2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(C)C(C)C(OC(=O)NCc2ccc(F)c(F)c2)C1(C)O |
|
AD19235 | -2.82 | 330.3 | C12H18O7N4 | COC(=O)c1cn(C2OC(CO)C(O)C(O)C2NC(C)=O)nn1 |
|
AD19236 | 3.89 | 867.13 | C45H78O12N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc(OC)c(OC3CCCC3)c2)C(C)C(O)C1(C)O |
|
AD19237 | -0.67 | 259.25 | C11H11O2N6 | CC(=O)NC1=NN(CCO)c2ncnc3c2C1=C[N]3 |
|
AD19238 | 3.54 | 373.44 | C21H21ON6 | CC(C)Oc1cc(CNC2=Nc3c(N)ncnc3[N]2)ccc1-c1ccccc1 |
|
AD19239 | 0.25 | 291.31 | C14H17O4N3 | COc1ccc2[nH]cc(CC(N)C(=O)NCC(=O)O)c2c1 |
|
AD19240 | 2.0 | 226.71 | C12H15ON2Cl | CCc1ccnc(C(=O)NCC(C)Cl)c1 |